5-(acetyloxymethyl)-1-cyclopropyl-6,8-bis(fluoranyl)-2-(2-methylpyridin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-(acetyloxymethyl)-1-cyclopropyl-6,8-bis(fluoranyl)-2-(2-methylpyridin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-(acetoxymethyl)-1-cyclopropyl-6,8-difluoro-2-(2-methyl-4-pyridyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-(acetyloxymethyl)-1-cyclopropyl-6,8-difluoro-2-(2-methyl-4-pyridinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-(acetyloxymethyl)-1-cyclopropyl-6,8-difluoro-2-(2-methylpyridin-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-(acetoxymethyl)-1-cyclopropyl-6,8-difluoro-4-keto-2-(2-methyl-4-pyridyl)quinoline-3-carboxylic acid Formula: C22H18F2N2O5 MolecularWeight: 428.385526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=C(C(=O)C3=C(C(=CC(=C3N2C4CC4)F)F)COC(=O)C)C(=O)O

Isomeric SMILES

CC1=NC=CC(=C1)C2=C(C(=O)C3=C(C(=CC(=C3N2C4CC4)F)F)COC(=O)C)C(=O)O

InChI

InChI=1S/C22H18F2N2O5/c1-10-7-12(5-6-25-10)19-18(22(29)30)21(28)17-14(9-31-11(2)27)15(23)8-16(24)20(17)26(19)13-3-4-13/h5-8,13H,3-4,9H2,1-2H3,(H,29,30)